4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine

C15H11N5OS — CID 91527481

IUPAC4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine
SMILESNc1nc(-c2cn[nH]c2-c2ccco2)c(-c2ccccn2)s1
InChIInChI=1S/C15H11N5OS/c16-15-19-13(14(22-15)10-4-1-2-6-17-10)9-8-18-20-12(9)11-5-3-7-21-11/h1-8H,(H2,16,19)(H,18,20)
InChIKeyMLWZXGHKXAVHAG-UHFFFAOYSA-N
MW309.35 g/mol
LogP3.44
Rot. Bonds3

About 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine

4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine (PubChem CID 91527481) has the molecular formula C15H11N5OS and a molecular weight of 309.35 g/mol. Its IUPAC name is 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine
PubChem CID91527481
Molecular FormulaC15H11N5OS
Molecular Weight309.35 g/mol
Exact Mass309.07
IUPAC Name4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine
SMILESNc1nc(-c2cn[nH]c2-c2ccco2)c(-c2ccccn2)s1
InChIInChI=1S/C15H11N5OS/c16-15-19-13(14(22-15)10-4-1-2-6-17-10)9-8-18-20-12(9)11-5-3-7-21-11/h1-8H,(H2,16,19)(H,18,20)
InChIKeyMLWZXGHKXAVHAG-UHFFFAOYSA-N
XLogP3.44
TPSA93.62 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.35
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(E)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3-thiazol-2-amine
CID 127031706
4-(1-benzofuran-2-yl)-N-[(Z)-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]-1,3-thiazol-2-amine
CID 76329790
4-Pyridinecarboxamide,n-[4-(2-furanyl)-5-(4-pyridinyl)-2-thiazolyl]-
CID 23144095
1-(3-(furan-2-yl)-1H-pyrazole-5-carbonyl)-N-(thiazol-2-yl)piperidine-4-carboxamide
CID 49676974
5-[1-(4-fluorobenzyl)-1H-pyrazol-3-yl]-N-(2-furylmethyl)-4-methyl-1,3-thiazol-2-amine
CID 42452094
2-Amino-5-(2-fluoropyridin-4-yl)-4-(2-furyl)thiazole
CID 23144562
2-fluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-1,3-thiazol-2-yl]benzamide
CID 56848351
2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-1,3-thiazol-2-yl]benzamide
CID 56848353
N-(3-fluoro-5-methyl-2-pyridinyl)-5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]thiophene-2-carboxamide
CID 68062169
3-fluoro-N-[2-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-1,3-thiazol-5-yl]pyridine-4-carboxamide
CID 118227496
3,5-difluoro-N-[2-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-1,3-thiazol-5-yl]pyridine-4-carboxamide
CID 118227498
2-fluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-1,3-thiazol-2-yl]cyclohexa-1,5-diene-1-carboxamide
CID 144338865

Frequently Asked Questions

What is the IUPAC name of 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine (CID 91527481) is 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine is Nc1nc(-c2cn[nH]c2-c2ccco2)c(-c2ccccn2)s1.
What is the InChIKey of 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine?
The InChIKey is MLWZXGHKXAVHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N5OS/c16-15-19-13(14(22-15)10-4-1-2-6-17-10)9-8-18-20-12(9)11-5-3-7-21-11/h1-8H,(H2,16,19)(H,18,20).
What are the key properties of 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine?
4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine has a molecular weight of 309.35 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(furan-2-yl)-1H-pyrazol-4-yl]-5-pyridin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 91527481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).